1-(2-morpholin-4-ium-4-ylethyl)-3-[3-(phenylmethyl)-1,3-thiazol-2-ylidene]thiourea

Systemtic Name: 1-(2-morpholin-4-ium-4-ylethyl)-3-[3-(phenylmethyl)-1,3-thiazol-2-ylidene]thiourea Openeye Name: 1-(3-benzylthiazol-2-ylidene)-3-(2-morpholin-4-ium-4-ylethyl)thiourea CAS Name: 1-[2-(4-morpholin-4-iumyl)ethyl]-3-[3-(phenylmethyl)-2-thiazolylidene]thiourea IUPAC Name: 1-(3-benzyl-1,3-thiazol-2-ylidene)-3-(2-morpholin-4-ium-4-ylethyl)thiourea Traditional Name: 1-(3-benzyl-4-thiazolin-2-ylidene)-3-(2-morpholin-4-ium-4-ylethyl)thiourea Formula: C17H23N4OS2+ MolecularWeight: 363.52072

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCNC(=S)N=C2N(C=CS2)CC3=CC=CC=C3

Isomeric SMILES

C1COCC[NH+]1CCNC(=S)N=C2N(C=CS2)CC3=CC=CC=C3

InChI

InChI=1S/C17H22N4OS2/c23-16(18-6-7-20-8-11-22-12-9-20)19-17-21(10-13-24-17)14-15-4-2-1-3-5-15/h1-5,10,13H,6-9,11-12,14H2,(H,18,23)/p+1