1-[(6-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)carbonylamino]-1-(1-phenylethyl)thiourea

Systemtic Name: 1-[(6-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)carbonylamino]-1-(1-phenylethyl)thiourea Openeye Name: 1-[(6-tert-butyl-4,5,6,7-tetrahydrobenzothiophene-3-carbonyl)amino]-1-(1-phenylethyl)thiourea CAS Name: 1-[[(6-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)-oxomethyl]amino]-1-(1-phenylethyl)thiourea IUPAC Name: 1-[(6-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonyl)amino]-1-(1-phenylethyl)thiourea Traditional Name: 1-[(6-tert-butyl-4,5,6,7-tetrahydrobenzothiophene-3-carbonyl)amino]-1-(1-phenylethyl)thiourea Formula: C22H29N3OS2 MolecularWeight: 415.61516

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)N(C(=S)N)NC(=O)C2=CSC3=C2CCC(C3)C(C)(C)C

Isomeric SMILES

CC(C1=CC=CC=C1)N(C(=S)N)NC(=O)C2=CSC3=C2CCC(C3)C(C)(C)C

InChI

InChI=1S/C22H29N3OS2/c1-14(15-8-6-5-7-9-15)25(21(23)27)24-20(26)18-13-28-19-12-16(22(2,3)4)10-11-17(18)19/h5-9,13-14,16H,10-12H2,1-4H3,(H2,23,27)(H,24,26)