N-[1-(1,3-benzodioxol-5-yl)-2-cyclopropyl-ethyl]-4-(2-chloranyl-4-methoxy-5-methyl-phenyl)-5-methyl-N-prop-2-ynyl-1,3-thiazol-2-amine

Systemtic Name: N-[1-(1,3-benzodioxol-5-yl)-2-cyclopropyl-ethyl]-4-(2-chloranyl-4-methoxy-5-methyl-phenyl)-5-methyl-N-prop-2-ynyl-1,3-thiazol-2-amine Openeye Name: N-[1-(1,3-benzodioxol-5-yl)-2-cyclopropyl-ethyl]-4-(2-chloro-4-methoxy-5-methyl-phenyl)-5-methyl-N-prop-2-ynyl-thiazol-2-amine CAS Name: N-[1-(1,3-benzodioxol-5-yl)-2-cyclopropylethyl]-4-(2-chloro-4-methoxy-5-methylphenyl)-5-methyl-N-prop-2-ynyl-2-thiazolamine IUPAC Name: N-[1-(1,3-benzodioxol-5-yl)-2-cyclopropylethyl]-4-(2-chloro-4-methoxy-5-methylphenyl)-5-methyl-N-prop-2-ynyl-1,3-thiazol-2-amine Traditional Name: [1-(1,3-benzodioxol-5-yl)-2-cyclopropyl-ethyl]-[4-(2-chloro-4-methoxy-5-methyl-phenyl)-5-methyl-thiazol-2-yl]-propargyl-amine Formula: C27H27ClN2O3S MolecularWeight: 495.03288

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=C1)C2=C(SC(=N2)N(CC#C)C(CC3CC3)C4=CC5=C(C=C4)OCO5)C)Cl)OC

Isomeric SMILES

CC1=C(C=C(C(=C1)C2=C(SC(=N2)N(CC#C)C(CC3CC3)C4=CC5=C(C=C4)OCO5)C)Cl)OC

InChI

InChI=1S/C27H27ClN2O3S/c1-5-10-30(22(12-18-6-7-18)19-8-9-23-25(13-19)33-15-32-23)27-29-26(17(3)34-27)20-11-16(2)24(31-4)14-21(20)28/h1,8-9,11,13-14,18,22H,6-7,10,12,15H2,2-4H3