2-[[5-(1H-indol-2-yl)-2-methoxy-phenyl]sulfanylcarbamoylamino]ethylcarbamic acid

Systemtic Name: 2-[[5-(1H-indol-2-yl)-2-methoxy-phenyl]sulfanylcarbamoylamino]ethylcarbamic acid Openeye Name: 2-[[5-(1H-indol-2-yl)-2-methoxy-phenyl]sulfanylcarbamoylamino]ethylcarbamic acid CAS Name: 2-[[[[[5-(1H-indol-2-yl)-2-methoxyphenyl]thio]amino]-oxomethyl]amino]ethylcarbamic acid IUPAC Name: 2-[[5-(1H-indol-2-yl)-2-methoxyphenyl]sulfanylcarbamoylamino]ethylcarbamic acid Traditional Name: 2-[[[5-(1H-indol-2-yl)-2-methoxy-phenyl]thio]carbamoylamino]ethylcarbamic acid Formula: C19H20N4O4S MolecularWeight: 400.4515

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CC3=CC=CC=C3N2)SNC(=O)NCCNC(=O)O

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CC3=CC=CC=C3N2)SNC(=O)NCCNC(=O)O

InChI

InChI=1S/C19H20N4O4S/c1-27-16-7-6-13(15-10-12-4-2-3-5-14(12)22-15)11-17(16)28-23-18(24)20-8-9-21-19(25)26/h2-7,10-11,21-22H,8-9H2,1H3,(H,25,26)(H2,20,23,24)