1-[(Z)-[(3S)-3-methylcyclohexylidene]amino]-3-(3-morpholin-4-ium-4-ylpropyl)thiourea

Systemtic Name: 1-[(Z)-[(3S)-3-methylcyclohexylidene]amino]-3-(3-morpholin-4-ium-4-ylpropyl)thiourea Openeye Name: 1-[(Z)-[(3S)-3-methylcyclohexylidene]amino]-3-(3-morpholin-4-ium-4-ylpropyl)thiourea CAS Name: 1-[(Z)-[(3S)-3-methylcyclohexylidene]amino]-3-[3-(4-morpholin-4-iumyl)propyl]thiourea IUPAC Name: 1-[(Z)-[(3S)-3-methylcyclohexylidene]amino]-3-(3-morpholin-4-ium-4-ylpropyl)thiourea Traditional Name: 1-[(Z)-[(3S)-3-methylcyclohexylidene]amino]-3-(3-morpholin-4-ium-4-ylpropyl)thiourea Formula: C15H29N4OS+ MolecularWeight: 313.48196

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(=NNC(=S)NCCC[NH+]2CCOCC2)C1

Isomeric SMILES

C[C@H]1CCC/C(=N/NC(=S)NCCC[NH+]2CCOCC2)/C1

InChI

InChI=1S/C15H28N4OS/c1-13-4-2-5-14(12-13)17-18-15(21)16-6-3-7-19-8-10-20-11-9-19/h13H,2-12H2,1H3,(H2,16,18,21)/p+1/b17-14-/t13-/m0/s1