1-[1-[3-(diethylaminomethyl)-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene]ethylamino]-3-(4-methoxyphenyl)thiourea

Systemtic Name: 1-[1-[3-(diethylaminomethyl)-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene]ethylamino]-3-(4-methoxyphenyl)thiourea Openeye Name: 1-[1-[3-(diethylaminomethyl)-4-oxo-cyclohexa-2,5-dien-1-ylidene]ethylamino]-3-(4-methoxyphenyl)thiourea CAS Name: 1-[1-[3-(diethylaminomethyl)-4-oxo-1-cyclohexa-2,5-dienylidene]ethylamino]-3-(4-methoxyphenyl)thiourea IUPAC Name: 1-[1-[3-(diethylaminomethyl)-4-oxocyclohexa-2,5-dien-1-ylidene]ethylamino]-3-(4-methoxyphenyl)thiourea Traditional Name: 1-[1-[3-(diethylaminomethyl)-4-keto-cyclohexa-2,5-dien-1-ylidene]ethylamino]-3-(4-methoxyphenyl)thiourea Formula: C21H28N4O2S MolecularWeight: 400.53762

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1=CC(=C(C)NNC(=S)NC2=CC=C(C=C2)OC)C=CC1=O

Isomeric SMILES

CCN(CC)CC1=CC(=C(C)NNC(=S)NC2=CC=C(C=C2)OC)C=CC1=O

InChI

InChI=1S/C21H28N4O2S/c1-5-25(6-2)14-17-13-16(7-12-20(17)26)15(3)23-24-21(28)22-18-8-10-19(27-4)11-9-18/h7-13,23H,5-6,14H2,1-4H3,(H2,22,24,28)