1-[4-(4-azanylphenoxy)phenyl]-3-[3-methyl-1,1-bis(oxidanylidene)thiolan-3-yl]thiourea

Systemtic Name: 1-[4-(4-azanylphenoxy)phenyl]-3-[3-methyl-1,1-bis(oxidanylidene)thiolan-3-yl]thiourea Openeye Name: 1-[4-(4-aminophenoxy)phenyl]-3-(3-methyl-1,1-dioxo-thiolan-3-yl)thiourea CAS Name: 1-[4-(4-aminophenoxy)phenyl]-3-(3-methyl-1,1-dioxo-3-thiolanyl)thiourea IUPAC Name: 1-[4-(4-aminophenoxy)phenyl]-3-(3-methyl-1,1-dioxothiolan-3-yl)thiourea Traditional Name: 1-[4-(4-aminophenoxy)phenyl]-3-(1,1-diketo-3-methyl-thiolan-3-yl)thiourea Formula: C18H21N3O3S2 MolecularWeight: 391.50764

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCS(=O)(=O)C1)NC(=S)NC2=CC=C(C=C2)OC3=CC=C(C=C3)N

Isomeric SMILES

CC1(CCS(=O)(=O)C1)NC(=S)NC2=CC=C(C=C2)OC3=CC=C(C=C3)N

InChI

InChI=1S/C18H21N3O3S2/c1-18(10-11-26(22,23)12-18)21-17(25)20-14-4-8-16(9-5-14)24-15-6-2-13(19)3-7-15/h2-9H,10-12,19H2,1H3,(H2,20,21,25)