1-[2-(1,3-benzothiazol-2-ylamino)ethanoylamino]-3-[(1S,2S)-2-methylcyclohexyl]thiourea

Systemtic Name: 1-[2-(1,3-benzothiazol-2-ylamino)ethanoylamino]-3-[(1S,2S)-2-methylcyclohexyl]thiourea Openeye Name: 1-[[2-(1,3-benzothiazol-2-ylamino)acetyl]amino]-3-[(1S,2S)-2-methylcyclohexyl]thiourea CAS Name: 1-[[2-(1,3-benzothiazol-2-ylamino)-1-oxoethyl]amino]-3-[(1S,2S)-2-methylcyclohexyl]thiourea IUPAC Name: 1-[[2-(1,3-benzothiazol-2-ylamino)acetyl]amino]-3-[(1S,2S)-2-methylcyclohexyl]thiourea Traditional Name: 1-[[2-(1,3-benzothiazol-2-ylamino)acetyl]amino]-3-[(1S,2S)-2-methylcyclohexyl]thiourea Formula: C17H23N5OS2 MolecularWeight: 377.52742

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=S)NNC(=O)CNC2=NC3=CC=CC=C3S2

Isomeric SMILES

C[C@H]1CCCC[C@@H]1NC(=S)NNC(=O)CNC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C17H23N5OS2/c1-11-6-2-3-7-12(11)19-16(24)22-21-15(23)10-18-17-20-13-8-4-5-9-14(13)25-17/h4-5,8-9,11-12H,2-3,6-7,10H2,1H3,(H,18,20)(H,21,23)(H2,19,22,24)/t11-,12-/m0/s1