1-[[(5S)-5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]carbonylamino]-3-phenethyl-thiourea

Systemtic Name: 1-[[(5S)-5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]carbonylamino]-3-phenethyl-thiourea Openeye Name: 1-[[(5S)-5-methyl-4,5,6,7-tetrahydrobenzothiophene-2-carbonyl]amino]-3-phenethyl-thiourea CAS Name: 1-[[[(5S)-5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-oxomethyl]amino]-3-phenethylthiourea IUPAC Name: 1-[[(5S)-5-methyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carbonyl]amino]-3-phenethylthiourea Traditional Name: 1-[[(5S)-5-methyl-4,5,6,7-tetrahydrobenzothiophene-2-carbonyl]amino]-3-phenethyl-thiourea Formula: C19H23N3OS2 MolecularWeight: 373.53542

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)C=C(S2)C(=O)NNC(=S)NCCC3=CC=CC=C3

Isomeric SMILES

C[C@H]1CCC2=C(C1)C=C(S2)C(=O)NNC(=S)NCCC3=CC=CC=C3

InChI

InChI=1S/C19H23N3OS2/c1-13-7-8-16-15(11-13)12-17(25-16)18(23)21-22-19(24)20-10-9-14-5-3-2-4-6-14/h2-6,12-13H,7-11H2,1H3,(H,21,23)(H2,20,22,24)/t13-/m0/s1