N-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-N-methyl-4-[(propan-2-ylcarbamoylamino)methyl]benzamide

Systemtic Name: N-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-N-methyl-4-[(propan-2-ylcarbamoylamino)methyl]benzamide Openeye Name: N-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-4-[(isopropylcarbamoylamino)methyl]-N-methyl-benzamide CAS Name: N-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-N-methyl-4-[[[oxo-(propan-2-ylamino)methyl]amino]methyl]benzamide IUPAC Name: N-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-N-methyl-4-[(propan-2-ylcarbamoylamino)methyl]benzamide Traditional Name: N-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-4-[(isopropylcarbamoylamino)methyl]-N-methyl-benzamide Formula: C22H26N4O2S MolecularWeight: 410.53244

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NCC1=CC=C(C=C1)C(=O)N(C)C(C)C2=NC3=CC=CC=C3S2

Isomeric SMILES

C[C@H](C1=NC2=CC=CC=C2S1)N(C)C(=O)C3=CC=C(C=C3)CNC(=O)NC(C)C

InChI

InChI=1S/C22H26N4O2S/c1-14(2)24-22(28)23-13-16-9-11-17(12-10-16)21(27)26(4)15(3)20-25-18-7-5-6-8-19(18)29-20/h5-12,14-15H,13H2,1-4H3,(H2,23,24,28)/t15-/m1/s1